SCHEMBL20999620

SCHEMBL20999620

CC1(NC(=O)COc2cccc(Cl)c2)C=C(NC(=O)COc2ccc(Cl)cc2)C1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ NOTUM Q6P988 2/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ HPGD P15428 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20999053 0.92 ALDH1A1 (0.47) ALDH1A1LMNANOTUML3MBTL1NPC1
SCHEMBL20999196 0.91 ATF4 (0.59) ATF4ALDH1A1LMNAL3MBTL1NPC1
SCHEMBL20999171 0.91 ATF4 (0.47) ATF4ALDH1A1LMNAL3MBTL1NPC1
SCHEMBL22669127 0.89 ATF4 (0.48) ATF4ALDH1A1LMNANOTUMMAPT
SCHEMBL22669222 0.87 ATF4 (0.54) ATF4ALDH1A1LMNAL3MBTL1NPC1
SCHEMBL22669132 0.86 ATF4 (0.53) ATF4ALDH1A1LMNAL3MBTL1NPC1
SCHEMBL20999043 0.85 MAPT (0.42) ALDH1A1LMNANOTUMMAPTTP53
SCHEMBL20999051 0.85 ALDH1A1 (0.41) ALDH1A1LMNANOTUMMAPTTP53
SCHEMBL22668975 0.83 MAPT (0.46) ATF4ALDH1A1LMNAMAPTMEN1
SCHEMBL20999208 0.82 ATF4 (0.44) ATF4MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190144440-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2019-05-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190144440-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 ATF4 1/4885ALDH1A1 3433/4885LMNA 3376/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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